#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gau h GLY 11 N 0.00 0.66 2.00 -0.72 0.00 -1.88 -2.09 103.07 101.04 2gau h GLY 11 Ca 0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 2gau h GLY 11 CO 0.00 0.22 -0.01 1.12 0.00 0.00 0.00 176.54 177.87 2gau h HIS 12 N 0.61 0.00 0.00 5.60 2.07 -1.98 -2.17 115.15 119.28 2gau h HIS 12 Ca 0.19 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.69 2gau h HIS 12 Cb 0.02 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.00 2gau h HIS 12 CO -0.00 0.01 -0.11 -0.07 -3.07 0.00 0.00 177.93 174.69 2gau h LEU 13 N 0.00 0.00 -6.90 6.12 3.38 -1.86 -3.26 115.31 112.79 2gau h LEU 13 Ca -0.00 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.26 2gau h LEU 13 Cb 0.19 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.86 2gau h LEU 13 CO 0.00 0.11 2.53 0.18 0.09 0.00 0.00 178.44 181.36 2gau n LEU 14 N -3.57 5.97 -0.05 1.67 4.32 -0.82 -4.87 117.00 119.65 2gau n LEU 14 Ca -0.02 -4.13 -0.08 0.00 -0.02 0.00 0.00 56.01 51.77 2gau n LEU 14 Cb 0.24 -1.67 -0.01 0.00 -1.62 0.00 0.00 43.42 40.35 2gau n LEU 14 CO 0.29 0.73 0.72 -0.09 -1.22 0.00 0.00 177.39 177.83 2gau h ARG 15 N 6.67 -0.18 -0.11 3.23 2.43 -1.83 -0.08 114.38 124.51 2gau h ARG 15 Ca 0.49 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.66 2gau h ARG 15 Cb 0.75 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.33 2gau h ARG 15 CO 1.65 -0.12 0.04 -0.44 -1.51 0.00 0.00 179.97 179.58 2gau h ASP 16 N -0.19 0.15 -0.34 -3.80 3.32 -1.92 -3.14 116.42 110.51 2gau h ASP 16 Ca 0.14 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 56.93 2gau h ASP 16 Cb 0.41 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2gau h ASP 16 CO -0.37 0.30 -0.07 0.58 -1.72 0.00 0.00 179.24 177.95 2gau h VAL 17 N -0.00 1.28 -0.93 -1.35 2.07 -1.91 -3.18 116.25 112.22 2gau h VAL 17 Ca 0.04 -1.12 0.13 0.00 0.82 0.00 0.00 66.70 66.56 2gau h VAL 17 Cb 0.20 1.32 -0.07 0.00 -1.52 0.00 0.00 31.29 31.21 2gau h VAL 17 CO -0.00 0.37 0.59 -0.25 0.02 0.00 0.00 177.57 178.30 2gau h TRP 18 N 0.43 0.96 0.00 1.57 2.91 -1.03 -0.45 115.95 120.34 2gau h TRP 18 Ca 0.09 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.13 2gau h TRP 18 Cb 0.57 -0.31 0.00 0.00 -0.51 0.00 0.00 29.16 28.91 2gau h TRP 18 CO 0.05 0.38 0.00 0.66 -1.03 0.00 0.00 178.44 178.50 2gau h SER 19 N 0.84 0.00 0.56 2.65 4.64 -1.52 -2.66 113.55 118.06 2gau h SER 19 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 2gau h SER 19 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 2gau h SER 19 CO -0.22 0.00 -0.41 0.18 -0.87 0.00 0.00 176.83 175.51 2gau n LEU 20 N -2.87 0.44 -4.85 5.97 4.77 -0.18 -4.93 117.00 115.36 2gau n LEU 20 Ca -0.00 0.07 -0.35 0.00 -0.03 0.00 0.00 56.01 55.69 2gau n LEU 20 Cb 0.20 -0.28 -0.06 0.00 -2.33 0.00 0.00 43.42 40.94 2gau n LEU 20 CO 0.22 0.11 -0.19 -0.76 -1.33 0.00 0.00 177.39 175.43 2gau s LEU 21 N -2.97 4.22 0.00 2.23 1.43 -1.00 -4.79 118.68 117.80 2gau s LEU 21 Ca 0.12 0.36 -0.03 0.00 -1.03 0.00 0.00 54.13 53.55 2gau s LEU 21 Cb 0.18 -2.18 0.06 0.00 0.03 0.00 0.00 46.19 44.28 2gau s LEU 21 CO 0.66 0.36 0.40 -0.46 0.23 0.00 0.00 176.35 177.54 2gau n ASN 22 N 1.68 0.22 -0.16 2.29 0.23 -1.26 -4.79 115.26 113.46 2gau n ASN 22 Ca -0.17 -1.26 -0.10 0.00 -0.53 0.00 0.00 54.58 52.52 2gau n ASN 22 Cb 0.54 -0.28 -0.00 0.00 -2.08 0.00 0.00 39.78 37.95 2gau n ASN 22 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2gau h GLU 23 N 0.00 0.84 -0.59 -3.83 4.57 -1.99 -0.65 114.58 112.93 2gau h GLU 23 Ca -0.13 -0.28 -0.10 0.00 -1.18 0.00 0.00 59.36 57.68 2gau h GLU 23 Cb 0.40 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.90 2gau h GLU 23 CO 0.11 0.90 -0.00 1.49 -1.18 0.00 0.00 179.01 180.33 2gau h GLU 24 N 0.70 1.04 -0.37 1.92 4.81 -1.99 -1.93 114.58 118.75 2gau h GLU 24 Ca 0.13 -0.33 -0.16 0.00 -0.13 0.00 0.00 59.36 58.87 2gau h GLU 24 Cb 0.53 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 2gau h GLU 24 CO 0.03 1.02 -0.41 0.93 -0.73 0.00 0.00 179.01 179.85 2gau h GLU 25 N 0.95 0.93 -0.81 1.92 5.08 -1.88 -2.26 114.58 118.52 2gau h GLU 25 Ca 0.17 -0.50 -0.01 0.00 -1.00 0.00 0.00 59.36 58.02 2gau h GLU 25 Cb 0.55 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.79 2gau h GLU 25 CO 0.03 1.16 0.47 0.00 -1.00 0.00 0.00 179.01 179.67 2gau h ARG 26 N 0.76 1.11 -0.47 2.33 3.08 -1.05 -0.66 114.38 119.47 2gau h ARG 26 Ca 0.06 -0.11 0.01 0.00 0.07 0.00 0.00 59.98 60.01 2gau h ARG 26 Cb 1.00 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.80 2gau h ARG 26 CO 0.10 0.79 0.30 0.93 -1.07 0.00 0.00 179.97 181.02 2gau h GLU 27 N 1.11 0.58 -0.13 0.04 5.08 -1.24 0.27 114.58 120.29 2gau h GLU 27 Ca 0.29 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.61 2gau h GLU 27 Cb -0.02 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2gau h GLU 27 CO -0.05 0.39 0.06 1.25 -1.00 0.00 0.00 179.01 179.65 2gau h LEU 28 N 0.60 0.18 0.13 1.33 5.85 -1.14 -0.67 115.31 121.59 2gau h LEU 28 Ca 0.18 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.76 2gau h LEU 28 Cb -0.03 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 2gau h LEU 28 CO -0.06 0.27 -0.15 0.25 -0.34 0.00 0.00 178.44 178.42 2gau h LEU 29 N 0.07 -0.39 -1.11 2.25 5.85 -1.00 -0.91 115.31 120.07 2gau h LEU 29 Ca 0.05 0.04 0.14 0.00 0.84 0.00 0.00 57.88 58.94 2gau h LEU 29 Cb 0.15 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.23 2gau h LEU 29 CO -0.00 -0.22 0.61 0.44 -0.34 0.00 0.00 178.44 178.93 2gau h ASP 30 N -0.31 0.81 -0.17 1.25 3.32 -0.86 -0.30 116.42 120.16 2gau h ASP 30 Ca 0.01 0.05 -0.13 0.00 0.02 0.00 0.00 57.03 56.98 2gau h ASP 30 Cb 0.30 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 2gau h ASP 30 CO -0.05 0.41 -0.35 0.50 -1.72 0.00 0.00 179.24 178.03 2gau h LYS 31 N 0.86 0.68 0.00 3.56 3.64 -0.57 -3.35 116.57 121.39 2gau h LYS 31 Ca 0.49 -0.33 -0.20 0.00 -1.27 0.00 0.00 60.65 59.34 2gau h LYS 31 Cb 0.62 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.40 2gau h LYS 31 CO -0.26 0.93 -1.99 0.39 -2.27 0.00 0.00 179.45 176.26 2gau n GLU 32 N -4.06 0.66 -1.99 1.90 -0.58 -0.40 -4.96 120.64 111.21 2gau n GLU 32 Ca -0.01 -0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.32 2gau n GLU 32 Cb 0.50 -1.60 -0.01 0.00 -0.57 0.00 0.00 31.44 29.75 2gau n GLU 32 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 2gau s ILE 33 N -2.94 2.47 -0.03 -3.67 2.07 -0.19 -4.52 121.20 114.39 2gau s ILE 33 Ca -0.07 0.47 0.03 0.00 -1.41 0.00 0.00 60.65 59.66 2gau s ILE 33 Cb 0.09 -3.30 0.00 0.00 0.13 0.00 0.00 42.46 39.39 2gau s ILE 33 CO 0.85 0.11 -0.11 -1.10 -1.91 0.00 0.00 174.94 172.78 2gau s GLN 34 N -1.82 1.17 0.50 3.50 -1.52 -0.14 -4.98 119.66 116.36 2gau s GLN 34 Ca 0.51 -0.39 -0.23 0.00 -1.95 0.00 0.00 55.36 53.30 2gau s GLN 34 Cb -0.42 -1.07 -0.07 0.00 -0.22 0.00 0.00 33.01 31.23 2gau s GLN 34 CO 0.56 0.15 1.38 -2.14 -0.25 0.00 0.00 175.29 174.99 2gau s PRO 35 N 0.13 3.43 -0.27 2.91 0.02 -1.26 -0.26 135.00 139.70 2gau s PRO 35 Ca -0.03 2.30 -0.01 0.00 0.02 0.00 0.00 61.00 63.28 2gau s PRO 35 Cb -0.09 -2.46 0.08 0.00 0.02 0.00 0.00 34.50 32.06 2gau s PRO 35 CO 0.01 -0.98 0.05 0.12 -0.33 0.00 0.00 177.00 175.87 2gau s PHE 36 N -1.27 1.84 0.21 6.54 5.36 0.27 -4.79 117.98 126.15 2gau s PHE 36 Ca 0.66 -1.64 -0.32 0.00 -0.96 0.00 0.00 56.93 54.67 2gau s PHE 36 Cb -0.41 -1.62 -0.13 0.00 -0.34 0.00 0.00 43.02 40.51 2gau s PHE 36 CO 0.51 -0.80 1.58 -0.35 -1.46 0.00 0.00 175.22 174.69 2gau n PRO 37 N 4.82 2.36 -3.18 10.12 -0.04 -1.26 -3.76 135.00 144.05 2gau n PRO 37 Ca -0.05 0.85 -0.22 0.00 -0.04 0.00 0.00 63.50 64.04 2gau n PRO 37 Cb 0.44 -2.61 -0.06 0.00 -0.04 0.00 0.00 33.50 31.22 2gau n PRO 37 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2gau s LYS 39 N -0.51 3.62 0.12 0.00 2.20 -1.26 -0.50 119.74 123.41 2gau s LYS 39 Ca 0.34 1.77 -0.34 0.00 -0.36 0.00 0.00 55.97 57.38 2gau s LYS 39 Cb 0.13 -2.30 -0.17 0.00 -1.51 0.00 0.00 37.83 33.97 2gau s LYS 39 CO -0.15 -0.67 1.00 1.17 -0.36 0.00 0.00 175.35 176.34 2gau n LYS 40 N -0.71 0.55 -0.39 4.03 4.81 -1.25 -1.08 118.16 124.12 2gau n LYS 40 Ca 0.08 0.20 0.00 0.00 -0.87 0.00 0.00 58.31 57.72 2gau n LYS 40 Cb 0.48 -1.59 0.00 0.00 0.02 0.00 0.00 35.03 33.94 2gau n LYS 40 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2gau n ALA 41 N 1.21 0.00 -1.78 3.14 0.00 0.41 -4.92 120.51 118.56 2gau n ALA 41 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.31 2gau n ALA 41 Cb 0.19 -0.05 0.03 0.00 0.00 0.00 0.00 19.45 19.63 2gau n ALA 41 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2gau s SER 42 N -3.49 5.70 -0.12 0.00 1.04 -0.24 -4.76 113.70 111.82 2gau s SER 42 Ca 0.00 1.38 -0.00 0.00 0.48 0.00 0.00 55.95 57.81 2gau s SER 42 Cb 0.00 -2.30 -0.02 0.00 0.10 0.00 0.00 66.02 63.80 2gau s SER 42 CO 0.00 -1.21 -0.11 0.28 0.98 0.00 0.00 173.24 173.19 2gau s THR 43 N -3.19 3.27 -0.02 2.02 -1.32 -1.26 -1.73 115.64 113.40 2gau s THR 43 Ca 0.57 -0.59 -0.21 0.00 -1.21 0.00 0.00 61.69 60.24 2gau s THR 43 Cb -0.12 -2.37 -0.27 0.00 -1.51 0.00 0.00 72.50 68.22 2gau s THR 43 CO 0.54 0.53 1.00 0.58 -2.21 0.00 0.00 174.62 175.05 2gau h VAL 44 N 5.17 1.48 -3.30 5.08 2.07 -1.04 -3.48 116.25 122.22 2gau h VAL 44 Ca -0.30 -2.30 -0.01 0.00 0.82 0.00 0.00 66.70 64.91 2gau h VAL 44 Cb 1.20 2.90 -0.09 0.00 -1.52 0.00 0.00 31.29 33.78 2gau h VAL 44 CO 0.56 0.66 0.05 0.72 0.02 0.00 0.00 177.57 179.58 2gau s PHE 45 N -2.82 -0.06 0.07 1.57 -0.12 -1.24 -5.01 117.98 110.37 2gau s PHE 45 Ca -0.13 -0.31 0.09 0.00 -0.05 0.00 0.00 56.93 56.53 2gau s PHE 45 Cb 0.02 0.42 -0.03 0.00 -0.63 0.00 0.00 43.02 42.80 2gau s PHE 45 CO 0.82 -0.99 -0.23 -1.12 -0.05 0.00 0.00 175.22 173.65 2gau s SER 46 N -2.90 2.79 -0.03 1.98 0.01 -1.26 -1.38 113.70 112.91 2gau s SER 46 Ca 0.12 -0.61 -0.39 0.00 1.31 0.00 0.00 55.95 56.37 2gau s SER 46 Cb -0.02 -0.21 -0.18 0.00 0.21 0.00 0.00 66.02 65.81 2gau s SER 46 CO 0.01 0.17 1.27 1.21 0.41 0.00 0.00 173.24 176.30 2gau n GLU 47 N 1.52 0.54 0.00 12.44 2.13 -0.71 -0.85 120.64 135.71 2gau n GLU 47 Ca -0.18 0.19 0.00 0.00 0.66 0.00 0.00 57.16 57.84 2gau n GLU 47 Cb 0.53 -1.76 0.00 0.00 0.27 0.00 0.00 31.44 30.48 2gau n GLU 47 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2gau n GLY 48 N 2.30 2.10 3.76 8.31 0.00 0.11 -4.94 105.19 116.83 2gau n GLY 48 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2gau n GLY 48 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gau s ASP 49 N -1.63 5.90 -0.18 1.61 1.11 -0.03 -4.60 116.67 118.86 2gau s ASP 49 Ca 0.00 2.51 -0.24 0.00 0.18 0.00 0.00 52.55 55.01 2gau s ASP 49 Cb 0.00 -2.62 -0.02 0.00 1.07 0.00 0.00 42.92 41.35 2gau s ASP 49 CO 0.00 -1.12 0.76 -0.63 1.18 0.00 0.00 175.17 175.36 2gau s ILE 50 N -1.42 4.93 0.07 0.77 -1.09 -1.26 -0.54 121.20 122.67 2gau s ILE 50 Ca 0.65 1.46 -0.32 0.00 -2.23 0.00 0.00 60.65 60.21 2gau s ILE 50 Cb -0.34 -4.06 -0.11 0.00 -1.58 0.00 0.00 42.46 36.36 2gau s ILE 50 CO 0.41 0.06 1.83 -2.65 -1.23 0.00 0.00 174.94 173.36 2gau n PRO 51 N 5.17 2.59 -0.01 2.79 -0.02 -1.26 -4.86 135.00 139.40 2gau n PRO 51 Ca 0.02 0.94 0.01 0.00 -2.02 0.00 0.00 63.50 62.46 2gau n PRO 51 Cb 0.49 -2.82 -0.05 0.00 -0.02 0.00 0.00 33.50 31.10 2gau n PRO 51 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2gau n ASN 52 N 5.78 3.38 -4.00 2.55 5.03 -1.26 -4.94 115.26 121.80 2gau n ASN 52 Ca 0.19 0.00 -0.09 0.00 0.87 0.00 0.00 54.58 55.56 2gau n ASN 52 Cb 0.35 1.12 -0.10 0.00 -1.02 0.00 0.00 39.78 40.13 2gau n ASN 52 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 2gau s ASN 53 N -3.12 0.30 0.24 6.41 0.01 -1.26 -1.86 114.94 115.66 2gau s ASN 53 Ca -0.03 -0.64 -0.10 0.00 -0.71 0.00 0.00 52.86 51.39 2gau s ASN 53 Cb 0.04 0.15 -0.07 0.00 0.41 0.00 0.00 41.25 41.77 2gau s ASN 53 CO 0.29 -0.41 0.56 -0.76 -1.51 0.00 0.00 177.10 175.27 2gau s LEU 54 N -1.95 4.15 -0.03 0.60 1.02 0.77 -4.85 118.68 118.38 2gau s LEU 54 Ca -0.08 0.93 0.07 0.00 0.02 0.00 0.00 54.13 55.07 2gau s LEU 54 Cb -0.04 -3.70 -0.02 0.00 0.02 0.00 0.00 46.19 42.45 2gau s LEU 54 CO -0.04 -0.09 -0.23 -0.36 0.02 0.00 0.00 176.35 175.65 2gau s PHE 55 N -1.85 2.16 -0.15 0.29 0.08 -0.64 -0.40 117.98 117.47 2gau s PHE 55 Ca 0.48 -0.48 0.01 0.00 0.12 0.00 0.00 56.93 57.05 2gau s PHE 55 Cb -0.11 -1.40 -0.00 0.00 -0.57 0.00 0.00 43.02 40.94 2gau s PHE 55 CO 0.21 -0.09 -0.16 -0.47 -0.10 0.00 0.00 175.22 174.62 2gau s TYR 56 N -0.42 2.77 -0.69 0.36 5.04 0.30 -0.32 117.35 124.39 2gau s TYR 56 Ca 0.05 -1.05 -0.24 0.00 -2.44 0.00 0.00 57.07 53.39 2gau s TYR 56 Cb -0.10 -1.88 0.06 0.00 0.35 0.00 0.00 41.96 40.39 2gau s TYR 56 CO 0.00 -0.47 1.08 -1.17 -1.34 0.00 0.00 175.55 173.65 2gau s LEU 57 N 0.78 3.93 -0.08 6.97 2.96 -0.23 -0.91 118.68 132.10 2gau s LEU 57 Ca -0.06 -0.79 -0.26 0.00 -0.22 0.00 0.00 54.13 52.81 2gau s LEU 57 Cb -0.15 -2.47 -0.21 0.00 0.50 0.00 0.00 46.19 43.85 2gau s LEU 57 CO 0.00 -1.59 0.93 0.22 -1.32 0.00 0.00 176.35 174.59 2gau h TYR 58 N 9.74 -0.03 -3.85 5.38 3.20 -1.34 0.16 116.97 130.22 2gau h TYR 58 Ca -0.28 -0.00 -0.20 0.00 3.14 0.00 0.00 58.73 61.39 2gau h TYR 58 Cb 1.06 0.01 -0.24 0.00 1.54 0.00 0.00 36.73 39.10 2gau h TYR 58 CO 1.03 0.66 -0.70 -1.21 -1.64 0.00 0.00 178.16 176.30 2gau s GLU 59 N -3.08 0.17 0.00 1.82 2.02 -1.00 -4.35 118.70 114.29 2gau s GLU 59 Ca -0.16 -0.31 0.00 0.00 0.02 0.00 0.00 54.97 54.51 2gau s GLU 59 Cb -0.01 0.06 0.00 0.00 0.10 0.00 0.00 34.13 34.28 2gau s GLU 59 CO 0.62 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 176.29 2gau n GLY 60 N 2.30 -0.27 3.30 -1.39 0.00 -1.26 -0.67 105.19 107.19 2gau n GLY 60 Ca -0.18 -2.07 -0.11 0.00 0.00 0.00 0.00 46.02 43.65 2gau n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gau s LYS 61 N 0.00 0.43 -0.09 1.61 1.02 -1.26 -4.10 119.74 117.35 2gau s LYS 61 Ca 0.00 0.73 0.02 0.00 0.02 0.00 0.00 55.97 56.74 2gau s LYS 61 Cb 0.00 0.07 0.01 0.00 -0.52 0.00 0.00 37.83 37.39 2gau s LYS 61 CO 0.00 -0.12 -0.14 0.42 -0.92 0.00 0.00 175.35 174.58 2gau s ILE 62 N 1.01 1.36 -0.03 2.17 -1.09 -1.15 -0.72 121.20 122.76 2gau s ILE 62 Ca -0.06 -0.58 -0.15 0.00 -2.23 0.00 0.00 60.65 57.62 2gau s ILE 62 Cb -0.06 -1.25 -0.05 0.00 -1.58 0.00 0.00 42.46 39.52 2gau s ILE 62 CO -0.08 0.41 0.41 -1.59 -1.23 0.00 0.00 174.94 172.85 2gau s LYS 63 N 0.85 4.00 -0.23 2.79 -2.85 0.80 0.04 119.74 125.15 2gau s LYS 63 Ca -0.10 0.38 -0.06 0.00 -1.00 0.00 0.00 55.97 55.19 2gau s LYS 63 Cb -0.15 -3.27 -0.03 0.00 -2.06 0.00 0.00 37.83 32.32 2gau s LYS 63 CO 0.01 0.57 0.04 0.42 0.10 0.00 0.00 175.35 176.50 2gau s ILE 64 N -0.69 4.19 0.06 3.79 -1.09 -0.10 -1.22 121.20 126.14 2gau s ILE 64 Ca 0.23 -0.22 0.00 0.00 -2.23 0.00 0.00 60.65 58.44 2gau s ILE 64 Cb -0.16 -2.94 -0.04 0.00 -1.58 0.00 0.00 42.46 37.75 2gau s ILE 64 CO 0.12 0.38 -0.04 -1.48 -1.23 0.00 0.00 174.94 172.68 2gau s LEU 65 N 1.35 2.44 0.00 2.97 0.05 0.09 -0.50 118.68 125.08 2gau s LEU 65 Ca 0.05 -0.89 0.00 0.00 0.05 0.00 0.00 54.13 53.34 2gau s LEU 65 Cb -0.15 0.08 0.00 0.00 -2.05 0.00 0.00 46.19 44.07 2gau s LEU 65 CO 0.02 -0.48 0.00 -2.11 -0.55 0.00 0.00 176.35 173.23 2gau n ARG 66 N 0.40 0.00 0.00 1.48 1.85 -0.22 0.48 116.66 120.64 2gau n ARG 66 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.69 2gau n ARG 66 Cb 0.60 -0.17 0.00 0.00 -1.05 0.00 0.00 32.46 31.83 2gau n ARG 66 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2gau n ARG 72 N 0.00 0.00 -3.94 2.89 1.74 -1.26 -1.18 116.66 114.91 2gau n ARG 72 Ca 0.00 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 2gau n ARG 72 Cb 0.13 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.55 2gau n ARG 72 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2gau s PHE 73 N 0.00 3.36 -0.08 -1.55 0.08 -1.26 -5.12 117.98 113.41 2gau s PHE 73 Ca 0.00 -0.06 0.02 0.00 0.12 0.00 0.00 56.93 57.02 2gau s PHE 73 Cb 0.00 -1.59 0.01 0.00 -0.57 0.00 0.00 43.02 40.87 2gau s PHE 73 CO 0.00 0.41 -0.15 -1.58 -0.10 0.00 0.00 175.22 173.79 2gau s HIS 74 N -2.03 1.80 -0.36 0.36 5.65 -0.33 -4.97 115.29 115.42 2gau s HIS 74 Ca 0.35 -0.74 -0.17 0.00 0.25 0.00 0.00 55.06 54.75 2gau s HIS 74 Cb -0.09 -1.29 -0.00 0.00 -1.18 0.00 0.00 32.58 30.02 2gau s HIS 74 CO 0.29 -0.36 0.45 0.42 -0.65 0.00 0.00 174.74 174.89 2gau s ILE 75 N 0.71 5.07 0.03 0.89 1.01 -1.26 -1.06 121.20 126.59 2gau s ILE 75 Ca -0.13 0.14 0.10 0.00 0.00 0.00 0.00 60.65 60.75 2gau s ILE 75 Cb -0.16 -3.93 -0.17 0.00 0.01 0.00 0.00 42.46 38.21 2gau s ILE 75 CO 0.03 -0.21 1.16 0.77 0.00 0.00 0.00 174.94 176.69 2gau h SER 76 N 8.51 0.00 -4.67 3.58 4.64 -1.17 -3.44 113.55 121.00 2gau h SER 76 Ca -0.28 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.11 2gau h SER 76 Cb 1.13 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.06 2gau h SER 76 CO 0.75 0.89 0.44 0.00 -0.87 0.00 0.00 176.83 178.04 2gau s ARG 77 N -2.74 0.89 -0.25 4.77 1.70 -1.22 -5.03 118.95 117.06 2gau s ARG 77 Ca 0.00 -0.26 -0.02 0.00 -0.47 0.00 0.00 55.73 54.98 2gau s ARG 77 Cb 0.09 0.41 0.02 0.00 -0.57 0.00 0.00 34.95 34.90 2gau s ARG 77 CO 0.81 -0.37 -0.04 0.42 -1.08 0.00 0.00 175.30 175.03 2gau s ILE 78 N -2.93 3.05 0.25 4.99 1.01 -1.26 -0.93 121.20 125.39 2gau s ILE 78 Ca 0.03 -0.95 -0.30 0.00 0.00 0.00 0.00 60.65 59.43 2gau s ILE 78 Cb -0.01 -2.55 -0.09 0.00 0.01 0.00 0.00 42.46 39.82 2gau s ILE 78 CO -0.08 0.19 1.23 -0.69 0.00 0.00 0.00 174.94 175.60 2gau s VAL 79 N 1.36 3.21 0.23 2.92 1.01 0.11 -4.90 120.40 124.33 2gau s VAL 79 Ca 0.01 1.11 0.08 0.00 0.00 0.00 0.00 61.98 63.18 2gau s VAL 79 Cb -0.17 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 2gau s VAL 79 CO -0.03 0.22 0.09 -1.59 0.00 0.00 0.00 175.10 173.79 2gau s LYS 80 N -0.94 2.62 0.50 2.72 -2.85 -1.26 -2.93 119.74 117.60 2gau s LYS 80 Ca 0.51 -1.16 -0.22 0.00 -1.00 0.00 0.00 55.97 54.09 2gau s LYS 80 Cb -0.35 -2.40 -0.07 0.00 -2.06 0.00 0.00 37.83 32.94 2gau s LYS 80 CO 0.43 0.41 1.10 -2.30 0.10 0.00 0.00 175.35 175.08 2gau n PRO 81 N -0.80 1.36 -0.69 1.78 -0.02 -1.26 -2.43 135.00 132.94 2gau n PRO 81 Ca -0.08 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2gau n PRO 81 Cb 0.57 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 2gau n PRO 81 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gau n GLY 82 N 1.08 0.82 3.76 -1.23 0.00 0.54 -5.03 105.19 105.13 2gau n GLY 82 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 2gau n GLY 82 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2gau s GLN 83 N -0.31 2.79 0.25 1.61 -0.21 -1.02 -4.95 119.66 117.83 2gau s GLN 83 Ca 0.00 -0.82 -0.13 0.00 0.02 0.00 0.00 55.36 54.43 2gau s GLN 83 Cb 0.00 -2.63 -0.08 0.00 1.00 0.00 0.00 33.01 31.30 2gau s GLN 83 CO 0.00 0.52 0.63 -0.06 -2.12 0.00 0.00 175.29 174.27 2gau s PHE 84 N -1.55 3.45 0.14 0.91 0.08 -1.26 -1.06 117.98 118.68 2gau s PHE 84 Ca 0.29 1.07 -0.04 0.00 0.12 0.00 0.00 56.93 58.37 2gau s PHE 84 Cb -0.11 -2.41 -0.03 0.00 -0.57 0.00 0.00 43.02 39.90 2gau s PHE 84 CO 0.22 0.23 0.14 -0.59 -0.10 0.00 0.00 175.22 175.12 2gau s PHE 85 N -1.80 0.63 -0.57 0.36 -0.12 0.56 -4.79 117.98 112.24 2gau s PHE 85 Ca 0.48 -1.01 0.00 0.00 -0.05 0.00 0.00 56.93 56.35 2gau s PHE 85 Cb -0.12 -0.29 0.00 0.00 -0.63 0.00 0.00 43.02 41.98 2gau s PHE 85 CO 0.19 -0.59 0.00 0.41 -0.05 0.00 0.00 175.22 175.19 2gau n GLY 86 N -0.13 0.67 0.12 1.99 0.00 -1.26 -1.63 105.19 104.96 2gau n GLY 86 Ca -0.07 -0.15 -0.19 0.00 0.00 0.00 0.00 46.02 45.61 2gau n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gau h MET 87 N 0.21 0.32 -0.15 1.61 -0.00 -1.89 -3.37 114.93 111.66 2gau h MET 87 Ca -0.11 -0.54 0.05 0.00 -0.00 0.00 0.00 59.70 59.10 2gau h MET 87 Cb 0.75 0.20 -0.07 0.00 -0.00 0.00 0.00 31.60 32.48 2gau h MET 87 CO 0.16 1.21 -0.35 0.07 -0.00 0.00 0.00 176.91 178.00 2gau h ARG 88 N 0.09 -0.39 0.00 -0.10 0.11 -1.96 -2.12 114.38 110.01 2gau h ARG 88 Ca -0.26 0.03 -0.07 0.00 0.10 0.00 0.00 59.98 59.78 2gau h ARG 88 Cb 2.05 0.09 -0.01 0.00 1.11 0.00 0.00 29.97 33.21 2gau h ARG 88 CO 0.18 -0.26 -0.36 -1.00 0.10 0.00 0.00 179.97 178.64 2gau h PRO 89 N -0.41 0.00 0.34 0.08 0.13 -1.87 0.20 132.00 130.48 2gau h PRO 89 Ca 0.10 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.21 2gau h PRO 89 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 2gau h PRO 89 CO -0.38 0.36 -0.17 -0.92 -0.23 0.00 0.00 178.00 176.66 2gau h TYR 90 N 0.00 -0.43 -0.34 1.56 3.20 -1.62 -1.02 116.97 118.32 2gau h TYR 90 Ca -0.00 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.77 2gau h TYR 90 Cb 0.80 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.20 2gau h TYR 90 CO 0.00 -0.21 -0.13 0.74 -1.64 0.00 0.00 178.16 176.91 2gau h PHE 91 N -0.55 0.65 0.00 -3.82 0.04 -1.04 -2.88 116.94 109.34 2gau h PHE 91 Ca -0.05 -0.11 0.00 0.00 2.80 0.00 0.00 57.97 60.61 2gau h PHE 91 Cb 0.41 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.39 2gau h PHE 91 CO -0.03 0.70 0.00 0.00 -0.60 0.00 0.00 178.31 178.38 2gau h ALA 92 N 1.32 1.00 -5.56 2.45 0.00 -0.94 -3.47 119.26 114.05 2gau h ALA 92 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.74 2gau h ALA 92 Cb 0.55 0.00 0.18 0.00 0.00 0.00 0.00 17.79 18.52 2gau h ALA 92 CO 0.03 0.00 -0.85 0.39 0.00 0.00 0.00 179.25 178.82 2gau n GLU 93 N -2.39 -2.08 -4.28 0.00 1.02 -0.50 -5.05 120.64 107.36 2gau n GLU 93 Ca 0.05 0.83 -0.17 0.00 -0.02 0.00 0.00 57.16 57.84 2gau n GLU 93 Cb 0.40 -5.58 -0.09 0.00 -0.02 0.00 0.00 31.44 26.15 2gau n GLU 93 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2gau s GLU 94 N -4.59 1.53 0.68 3.49 2.02 -0.53 -5.06 118.70 116.24 2gau s GLU 94 Ca 0.45 -1.86 -0.11 0.00 0.02 0.00 0.00 54.97 53.47 2gau s GLU 94 Cb -0.07 0.12 -0.00 0.00 0.10 0.00 0.00 34.13 34.27 2gau s GLU 94 CO 0.76 -0.49 1.07 0.95 0.02 0.00 0.00 175.26 177.57 2gau s THR 95 N -3.72 3.84 0.14 3.63 -4.23 -1.26 -4.56 115.64 109.47 2gau s THR 95 Ca 0.38 0.57 -0.31 0.00 -1.18 0.00 0.00 61.69 61.15 2gau s THR 95 Cb 0.05 -3.59 -0.10 0.00 1.34 0.00 0.00 72.50 70.20 2gau s THR 95 CO 0.19 -0.77 1.70 0.00 -0.54 0.00 0.00 174.62 175.20 2gau n SER 97 N 4.85 0.09 -3.89 0.00 3.41 -1.26 0.04 113.62 116.86 2gau n SER 97 Ca 0.16 0.29 -0.09 0.00 -0.26 0.00 0.00 58.87 58.98 2gau n SER 97 Cb 0.38 -0.36 -0.07 0.00 -0.26 0.00 0.00 64.21 63.90 2gau n SER 97 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2gau s SER 98 N -2.94 0.15 -0.13 4.04 0.01 -1.26 -4.78 113.70 108.79 2gau s SER 98 Ca 0.16 -0.71 -0.07 0.00 1.31 0.00 0.00 55.95 56.64 2gau s SER 98 Cb 0.19 0.34 -0.04 0.00 0.21 0.00 0.00 66.02 66.71 2gau s SER 98 CO 0.54 -0.73 0.13 -0.89 0.41 0.00 0.00 173.24 172.70 2gau s THR 99 N -3.88 5.44 -0.22 1.44 2.01 0.18 -1.73 115.64 118.88 2gau s THR 99 Ca 0.07 0.19 -0.04 0.00 0.31 0.00 0.00 61.69 62.21 2gau s THR 99 Cb 0.05 -3.38 -0.01 0.00 0.01 0.00 0.00 72.50 69.17 2gau s THR 99 CO -0.10 0.60 -0.03 0.00 -0.69 0.00 0.00 174.62 174.41 2gau s ALA 100 N -0.90 2.87 -0.05 7.40 0.00 -0.48 -0.73 121.76 129.87 2gau s ALA 100 Ca 0.14 -1.13 0.04 0.00 0.00 0.00 0.00 51.96 51.01 2gau s ALA 100 Cb -0.12 -1.73 0.00 0.00 0.00 0.00 0.00 23.12 21.27 2gau s ALA 100 CO 0.03 -0.37 -0.16 0.42 0.00 0.00 0.00 175.76 175.69 2gau s ILE 101 N 1.38 1.37 0.09 0.00 1.01 -0.36 -0.29 121.20 124.40 2gau s ILE 101 Ca 0.05 -0.66 -0.31 0.00 0.00 0.00 0.00 60.65 59.73 2gau s ILE 101 Cb -0.14 -1.20 -0.07 0.00 0.01 0.00 0.00 42.46 41.06 2gau s ILE 101 CO -0.01 0.40 1.35 0.00 0.00 0.00 0.00 174.94 176.68 2gau s ALA 102 N 0.25 3.55 -0.10 9.38 0.00 -0.70 -0.14 121.76 133.99 2gau s ALA 102 Ca -0.08 1.03 0.14 0.00 0.00 0.00 0.00 51.96 53.05 2gau s ALA 102 Cb -0.13 -3.52 -0.06 0.00 0.00 0.00 0.00 23.12 19.40 2gau s ALA 102 CO 0.03 -0.61 1.16 0.28 0.00 0.00 0.00 175.76 176.62 2gau h VAL 103 N 4.39 0.85 -3.90 0.00 2.07 -1.27 0.12 116.25 118.51 2gau h VAL 103 Ca -0.41 -2.33 -0.11 0.00 0.82 0.00 0.00 66.70 64.67 2gau h VAL 103 Cb 1.21 2.34 -0.13 0.00 -1.52 0.00 0.00 31.29 33.19 2gau h VAL 103 CO 0.86 0.48 -0.34 -1.83 0.02 0.00 0.00 177.57 176.77 2gau s GLU 104 N -2.89 1.12 -0.08 1.57 -1.05 -1.23 -4.78 118.70 111.35 2gau s GLU 104 Ca 0.01 -1.17 -0.38 0.00 -0.15 0.00 0.00 54.97 53.28 2gau s GLU 104 Cb 0.08 0.37 -0.16 0.00 -0.44 0.00 0.00 34.13 33.98 2gau s GLU 104 CO 0.78 -0.40 1.55 0.09 0.95 0.00 0.00 175.26 178.23 2gau n ASN 105 N -0.20 2.09 -4.20 0.83 4.13 -1.26 -3.94 115.26 112.70 2gau n ASN 105 Ca -0.08 1.09 -0.17 0.00 1.68 0.00 0.00 54.58 57.10 2gau n ASN 105 Cb 0.63 -1.18 -0.11 0.00 -1.54 0.00 0.00 39.78 37.57 2gau n ASN 105 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2gau s SER 106 N 2.01 1.78 -0.37 6.41 0.01 0.35 -4.56 113.70 119.33 2gau s SER 106 Ca 0.91 -0.74 -0.08 0.00 1.31 0.00 0.00 55.95 57.35 2gau s SER 106 Cb -0.99 -0.05 0.05 0.00 0.21 0.00 0.00 66.02 65.24 2gau s SER 106 CO 0.55 -0.14 0.18 -0.54 0.41 0.00 0.00 173.24 173.70 2gau s LYS 107 N -2.34 2.64 -0.06 12.44 1.02 0.16 -3.70 119.74 129.89 2gau s LYS 107 Ca 0.04 -1.26 0.03 0.00 0.02 0.00 0.00 55.97 54.80 2gau s LYS 107 Cb -0.06 -3.63 -0.02 0.00 -0.52 0.00 0.00 37.83 33.59 2gau s LYS 107 CO 0.02 -0.77 -0.14 0.08 -0.92 0.00 0.00 175.35 173.62 2gau s VAL 108 N 1.44 3.04 -0.18 3.17 1.01 -1.25 -0.92 120.40 126.72 2gau s VAL 108 Ca 0.01 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 2gau s VAL 108 Cb -0.21 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 2gau s VAL 108 CO 0.03 0.58 0.01 -0.76 0.00 0.00 0.00 175.10 174.96 2gau s LEU 109 N -0.52 3.47 -0.20 3.92 1.43 -0.09 -0.57 118.68 126.13 2gau s LEU 109 Ca 0.07 -0.07 -0.09 0.00 -1.03 0.00 0.00 54.13 53.01 2gau s LEU 109 Cb -0.12 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 2gau s LEU 109 CO 0.02 0.14 0.10 0.00 0.23 0.00 0.00 176.35 176.84 2gau s ALA 110 N 0.55 3.52 -0.25 4.21 0.00 0.65 -0.53 121.76 129.89 2gau s ALA 110 Ca -0.00 -0.79 -0.01 0.00 0.00 0.00 0.00 51.96 51.16 2gau s ALA 110 Cb -0.14 -2.09 0.03 0.00 0.00 0.00 0.00 23.12 20.92 2gau s ALA 110 CO 0.02 0.04 -0.08 0.42 0.00 0.00 0.00 175.76 176.17 2gau s ILE 111 N 0.61 2.71 0.28 0.00 1.09 0.47 -0.97 121.20 125.39 2gau s ILE 111 Ca 0.06 -1.13 -0.30 0.00 -1.10 0.00 0.00 60.65 58.18 2gau s ILE 111 Cb -0.12 -2.40 -0.13 0.00 -1.06 0.00 0.00 42.46 38.74 2gau s ILE 111 CO 0.01 0.17 1.27 -2.65 -0.10 0.00 0.00 174.94 173.64 2gau n PRO 112 N 4.63 1.87 0.01 2.79 -0.02 -1.26 -0.17 135.00 142.85 2gau n PRO 112 Ca -0.16 0.66 0.10 0.00 -2.02 0.00 0.00 63.50 62.08 2gau n PRO 112 Cb 0.46 -2.22 0.52 0.00 -0.02 0.00 0.00 33.50 32.24 2gau n PRO 112 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2gau h VAL 113 N 2.63 0.96 -0.52 -1.45 -1.51 -1.70 -0.88 116.25 113.78 2gau h VAL 113 Ca -0.44 -0.12 0.02 0.00 -1.23 0.00 0.00 66.70 64.93 2gau h VAL 113 Cb 1.30 0.59 -0.03 0.00 -2.13 0.00 0.00 31.29 31.01 2gau h VAL 113 CO 0.68 0.06 0.33 -0.33 -1.23 0.00 0.00 177.57 177.07 2gau h GLU 114 N 0.34 0.64 -0.38 5.19 3.07 -1.89 0.15 114.58 121.69 2gau h GLU 114 Ca 0.19 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.36 58.97 2gau h GLU 114 Cb 0.33 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.08 2gau h GLU 114 CO -0.04 0.42 0.06 0.00 -1.40 0.00 0.00 179.01 178.05 2gau h ALA 115 N 1.21 0.51 -0.36 3.43 0.00 -1.57 -2.28 119.26 120.20 2gau h ALA 115 Ca 0.20 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2gau h ALA 115 Cb -0.02 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.57 2gau h ALA 115 CO -0.07 0.22 0.06 0.82 0.00 0.00 0.00 179.25 180.28 2gau h ILE 116 N 0.48 0.81 -0.65 0.00 1.08 -0.88 -2.09 117.51 116.26 2gau h ILE 116 Ca 0.12 -0.06 -0.02 0.00 -0.39 0.00 0.00 64.86 64.51 2gau h ILE 116 Cb 0.37 0.61 -0.03 0.00 -3.07 0.00 0.00 36.82 34.70 2gau h ILE 116 CO 0.01 0.03 0.35 -0.08 -0.69 0.00 0.00 178.15 177.77 2gau h GLU 117 N 0.18 0.91 -0.64 2.37 4.81 -0.61 -0.64 114.58 120.96 2gau h GLU 117 Ca 0.17 -0.11 0.02 0.00 -0.13 0.00 0.00 59.36 59.31 2gau h GLU 117 Cb 0.20 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 2gau h GLU 117 CO -0.23 0.70 0.41 0.00 -0.73 0.00 0.00 179.01 179.15 2gau h ALA 118 N 1.16 0.83 -0.22 2.92 0.00 -1.22 -1.41 119.26 121.33 2gau h ALA 118 Ca 0.23 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2gau h ALA 118 Cb 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2gau h ALA 118 CO -0.03 0.18 0.04 -0.07 0.00 0.00 0.00 179.25 179.36 2gau h LEU 119 N 0.81 0.35 -0.85 0.00 3.38 -0.96 -3.03 115.31 115.00 2gau h LEU 119 Ca 0.25 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 58.00 2gau h LEU 119 Cb -0.02 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 2gau h LEU 119 CO -0.09 0.52 0.55 -0.07 0.09 0.00 0.00 178.44 179.44 2gau h LEU 120 N 0.16 0.90 -1.78 1.67 3.38 -0.99 -2.75 115.31 115.91 2gau h LEU 120 Ca 0.07 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.06 2gau h LEU 120 Cb 0.32 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2gau h LEU 120 CO 0.00 0.62 0.20 0.11 0.09 0.00 0.00 178.44 179.46 2gau h LYS 121 N 1.06 0.28 -0.01 1.13 1.57 -1.14 -3.05 116.57 116.40 2gau h LYS 121 Ca 0.34 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 2gau h LYS 121 Cb 0.02 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2gau h LYS 121 CO -0.12 0.18 -0.44 0.41 -0.57 0.00 0.00 179.45 178.92 2gau n GLY 122 N -1.52 0.04 2.65 3.86 0.00 -1.08 -4.91 105.19 104.23 2gau n GLY 122 Ca 0.02 -0.60 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 2gau n GLY 122 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2gau s ASN 123 N -2.33 2.57 0.36 1.61 3.84 -1.06 -5.01 114.94 114.92 2gau s ASN 123 Ca 0.17 -1.01 0.08 0.00 0.21 0.00 0.00 52.86 52.32 2gau s ASN 123 Cb 0.17 0.10 0.70 0.00 -0.55 0.00 0.00 41.25 41.67 2gau s ASN 123 CO 0.53 -0.41 1.87 0.71 -2.79 0.00 0.00 177.10 177.01 2gau h THR 124 N 6.33 1.20 -0.68 -5.21 1.35 -1.89 -2.28 112.91 111.73 2gau h THR 124 Ca -0.16 -0.91 0.02 0.00 -0.55 0.00 0.00 66.41 64.81 2gau h THR 124 Cb 1.04 1.26 -0.04 0.00 -1.73 0.00 0.00 68.15 68.68 2gau h THR 124 CO 0.39 0.28 0.44 0.28 -0.25 0.00 0.00 175.52 176.65 2gau h SER 125 N 0.26 0.73 -0.35 5.36 0.02 -1.95 0.15 113.55 117.77 2gau h SER 125 Ca 0.05 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2gau h SER 125 Cb 0.44 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 2gau h SER 125 CO 0.03 0.51 0.20 0.15 -1.14 0.00 0.00 176.83 176.58 2gau h PHE 126 N 0.87 0.48 -0.46 3.45 3.57 -1.80 -1.33 116.94 121.72 2gau h PHE 126 Ca 0.27 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.79 2gau h PHE 126 Cb -0.02 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 38.52 2gau h PHE 126 CO -0.04 0.38 0.23 0.00 -2.23 0.00 0.00 178.31 176.65 2gau h ARG 128 N 0.45 0.00 -0.29 0.00 3.08 -0.47 -1.02 114.38 116.12 2gau h ARG 128 Ca 0.20 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.27 2gau h ARG 128 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 2gau h ARG 128 CO -0.14 0.38 0.14 -0.92 -1.07 0.00 0.00 179.97 178.36 2gau h TYR 129 N 0.00 0.26 -0.02 3.04 3.20 -1.11 -1.88 116.97 120.47 2gau h TYR 129 Ca -0.00 0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.72 2gau h TYR 129 Cb 0.85 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.03 2gau h TYR 129 CO 0.00 0.14 -0.71 0.74 -1.64 0.00 0.00 178.16 176.69 2gau h PHE 130 N 0.30 0.19 -0.28 -3.82 0.04 -1.30 -1.96 116.94 110.10 2gau h PHE 130 Ca 0.12 -0.08 0.03 0.00 2.80 0.00 0.00 57.97 60.84 2gau h PHE 130 Cb 0.04 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.13 2gau h PHE 130 CO -0.10 0.80 0.08 -0.07 -0.60 0.00 0.00 178.31 178.42 2gau h LEU 131 N 0.09 0.06 -0.44 1.54 3.38 -1.09 0.80 115.31 119.65 2gau h LEU 131 Ca -0.02 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2gau h LEU 131 Cb 1.26 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 2gau h LEU 131 CO 0.10 0.07 0.16 0.50 0.09 0.00 0.00 178.44 179.37 2gau h LYS 132 N 0.20 0.67 -0.35 1.13 3.64 -1.22 -1.20 116.57 119.43 2gau h LYS 132 Ca 0.13 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2gau h LYS 132 Cb 0.11 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2gau h LYS 132 CO -0.15 0.63 0.23 0.00 -2.27 0.00 0.00 179.45 177.89 2gau h ALA 133 N 1.01 0.44 -0.57 5.00 0.00 -1.00 0.26 119.26 124.41 2gau h ALA 133 Ca 0.15 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 2gau h ALA 133 Cb 0.22 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2gau h ALA 133 CO -0.01 -0.10 0.01 -0.07 0.00 0.00 0.00 179.25 179.09 2gau h LEU 134 N 0.47 0.94 -0.52 0.00 3.38 -0.78 -1.81 115.31 116.99 2gau h LEU 134 Ca 0.13 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.77 2gau h LEU 134 Cb -0.05 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 2gau h LEU 134 CO -0.03 0.99 -0.01 0.00 0.09 0.00 0.00 178.44 179.48 2gau h ALA 135 N 1.11 0.70 -0.23 1.53 0.00 -0.80 -0.10 119.26 121.47 2gau h ALA 135 Ca 0.17 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.81 2gau h ALA 135 Cb 0.50 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2gau h ALA 135 CO 0.02 0.53 0.04 0.87 0.00 0.00 0.00 179.25 180.71 2gau h LYS 136 N 0.79 0.12 -0.76 0.00 1.79 -0.83 -0.92 116.57 116.76 2gau h LYS 136 Ca 0.15 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 2gau h LYS 136 Cb 0.54 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.12 2gau h LYS 136 CO 0.03 0.08 0.48 0.93 -1.08 0.00 0.00 179.45 179.89 2gau h GLU 137 N 0.12 1.02 -0.76 3.15 4.39 -1.09 -0.86 114.58 120.57 2gau h GLU 137 Ca 0.10 -0.08 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 2gau h GLU 137 Cb 0.11 -0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 28.50 2gau h GLU 137 CO -0.14 0.70 0.26 1.25 -1.16 0.00 0.00 179.01 179.92 2gau h LEU 138 N 1.04 1.08 -0.38 1.33 5.85 -0.80 0.37 115.31 123.82 2gau h LEU 138 Ca 0.28 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2gau h LEU 138 Cb -0.07 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.65 2gau h LEU 138 CO -0.06 0.99 0.24 1.23 -0.34 0.00 0.00 178.44 180.50 2gau h GLY 139 N 1.12 0.54 0.98 3.75 0.00 -0.51 -1.15 103.07 107.79 2gau h GLY 139 Ca 0.25 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 2gau h GLY 139 CO -0.01 0.21 0.27 -0.97 0.00 0.00 0.00 176.54 176.04 2gau h TYR 140 N 0.50 0.67 -0.12 5.60 0.05 -0.86 -2.21 116.97 120.61 2gau h TYR 140 Ca 0.14 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.90 2gau h TYR 140 Cb -0.02 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.50 2gau h TYR 140 CO -0.04 0.50 0.08 0.00 -1.05 0.00 0.00 178.16 177.65 2gau h ALA 141 N 1.11 0.15 -0.44 3.88 0.00 -0.66 -0.49 119.26 122.82 2gau h ALA 141 Ca 0.17 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 2gau h ALA 141 Cb 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2gau h ALA 141 CO -0.03 -0.36 -0.17 0.93 0.00 0.00 0.00 179.25 179.62 2gau h GLU 142 N 0.16 0.84 -0.49 0.00 5.08 -1.16 -1.79 114.58 117.22 2gau h GLU 142 Ca 0.04 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2gau h GLU 142 Cb -0.02 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 2gau h GLU 142 CO -0.01 0.95 0.32 -0.09 -1.00 0.00 0.00 179.01 179.18 2gau h ARG 143 N 0.74 0.64 -0.43 2.33 2.43 -1.30 -2.93 114.38 115.86 2gau h ARG 143 Ca 0.11 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 2gau h ARG 143 Cb 0.68 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 2gau h ARG 143 CO 0.05 0.43 0.08 -0.09 -1.51 0.00 0.00 179.97 178.93 2gau h ARG 144 N 0.66 0.65 -0.65 0.20 2.43 -0.56 -1.67 114.38 115.44 2gau h ARG 144 Ca 0.18 -0.13 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 2gau h ARG 144 Cb -0.07 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.34 2gau h ARG 144 CO -0.04 0.62 0.41 1.15 -1.51 0.00 0.00 179.97 180.60 2gau h THR 145 N 0.63 1.11 0.09 0.20 2.02 -1.16 0.79 112.91 116.59 2gau h THR 145 Ca 0.14 -0.28 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 2gau h THR 145 Cb 0.28 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 2gau h THR 145 CO 0.00 0.15 -0.04 0.58 0.37 0.00 0.00 175.52 176.58 2gau h VAL 146 N 0.82 1.04 -0.31 3.16 2.07 -1.32 -1.94 116.25 119.77 2gau h VAL 146 Ca 0.25 -0.48 0.07 0.00 0.82 0.00 0.00 66.70 67.36 2gau h VAL 146 Cb -0.02 1.35 -0.08 0.00 -1.52 0.00 0.00 31.29 31.02 2gau h VAL 146 CO -0.09 0.12 -0.30 0.74 0.02 0.00 0.00 177.57 178.06 2gau h THR 147 N -0.34 0.28 0.00 2.57 2.02 -1.13 -1.48 112.91 114.83 2gau h THR 147 Ca -0.01 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.06 2gau h THR 147 Cb 0.29 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 2gau h THR 147 CO 0.02 0.00 -0.51 -0.07 0.37 0.00 0.00 175.52 175.33 2gau h LEU 148 N -0.28 0.00 0.00 2.58 3.38 -0.80 -1.91 115.31 118.29 2gau h LEU 148 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2gau h LEU 148 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2gau h LEU 148 CO -0.46 0.51 -1.18 0.35 0.09 0.00 0.00 178.44 177.75 2gau n THR 149 N -3.86 0.49 -0.00 0.22 -2.24 -0.74 -4.65 114.28 103.50 2gau n THR 149 Ca -0.01 -0.53 -0.00 0.00 -2.27 0.00 0.00 64.05 61.24 2gau n THR 149 Cb 0.54 -0.26 -0.00 0.00 -2.10 0.00 0.00 70.33 68.50 2gau n THR 149 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gau n GLN 150 N -2.58 3.81 -2.61 -0.78 6.02 -0.57 -5.04 117.38 115.64 2gau n GLN 150 Ca -0.01 -0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.65 2gau n GLN 150 Cb 0.55 -1.00 -0.05 0.00 1.02 0.00 0.00 30.24 30.76 2gau n GLN 150 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2gau s LYS 151 N -2.00 4.02 0.85 -1.09 1.02 -0.72 -5.06 119.74 116.76 2gau s LYS 151 Ca -0.00 1.12 -0.12 0.00 0.02 0.00 0.00 55.97 56.99 2gau s LYS 151 Cb 0.00 -2.14 0.13 0.00 -0.52 0.00 0.00 37.83 35.29 2gau s LYS 151 CO 0.01 -0.21 1.20 -1.01 -0.92 0.00 0.00 175.35 174.41 2gau s HIS 152 N -2.29 2.32 0.24 3.18 3.76 -1.26 -4.70 115.29 116.54 2gau s HIS 152 Ca 0.62 0.46 -0.05 0.00 -0.15 0.00 0.00 55.06 55.94 2gau s HIS 152 Cb -0.11 -3.66 0.41 0.00 1.11 0.00 0.00 32.58 30.34 2gau s HIS 152 CO 0.21 -2.05 1.75 0.28 -0.85 0.00 0.00 174.74 174.07 2gau h VAL 153 N -1.17 0.72 -0.54 -0.90 2.07 -1.97 -0.65 116.25 113.81 2gau h VAL 153 Ca -0.44 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 2gau h VAL 153 Cb 1.29 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 2gau h VAL 153 CO 0.52 0.09 0.23 0.03 0.02 0.00 0.00 177.57 178.47 2gau h ARG 154 N 0.49 0.79 -0.22 1.57 3.08 -1.94 -2.19 114.38 115.97 2gau h ARG 154 Ca 0.39 -0.13 -0.05 0.00 0.07 0.00 0.00 59.98 60.26 2gau h ARG 154 Cb 0.54 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 2gau h ARG 154 CO -0.36 0.68 -0.04 0.78 -1.07 0.00 0.00 179.97 179.95 2gau h GLY 155 N 0.72 0.45 0.73 0.04 0.00 -1.43 -2.11 103.07 101.47 2gau h GLY 155 Ca 0.18 -0.36 0.03 0.00 0.00 0.00 0.00 47.33 47.18 2gau h GLY 155 CO -0.02 0.33 0.07 3.21 0.00 0.00 0.00 176.54 180.13 2gau h ARG 156 N 0.15 0.17 -0.27 4.80 3.08 -1.13 0.74 114.38 121.91 2gau h ARG 156 Ca 0.06 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 60.00 2gau h ARG 156 Cb 0.49 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2gau h ARG 156 CO 0.02 0.11 -0.21 1.25 -1.07 0.00 0.00 179.97 180.07 2gau h LEU 157 N 0.18 0.66 -0.77 3.04 5.85 -1.42 -1.29 115.31 121.55 2gau h LEU 157 Ca 0.12 -0.45 0.04 0.00 0.84 0.00 0.00 57.88 58.43 2gau h LEU 157 Cb 0.11 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 2gau h LEU 157 CO -0.14 0.97 0.48 0.00 -0.34 0.00 0.00 178.44 179.41 2gau h ALA 158 N 0.71 1.02 -0.03 1.25 0.00 -1.29 -0.80 119.26 120.13 2gau h ALA 158 Ca 0.05 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2gau h ALA 158 Cb 0.76 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2gau h ALA 158 CO 0.06 0.27 0.02 1.49 0.00 0.00 0.00 179.25 181.08 2gau h GLU 159 N 0.93 0.04 -0.36 0.00 4.81 -0.68 -1.09 114.58 118.24 2gau h GLU 159 Ca 0.32 -0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.62 2gau h GLU 159 Cb 0.05 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.34 2gau h GLU 159 CO -0.12 0.08 -0.22 1.15 -0.73 0.00 0.00 179.01 179.16 2gau h THR 160 N -0.01 0.39 -0.91 0.32 2.02 -0.90 -0.30 112.91 113.51 2gau h THR 160 Ca 0.01 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.20 2gau h THR 160 Cb 0.05 0.39 -0.05 0.00 -1.74 0.00 0.00 68.15 66.80 2gau h THR 160 CO -0.00 0.00 0.60 -0.07 0.37 0.00 0.00 175.52 176.42 2gau h LEU 161 N -0.17 1.04 -0.95 2.58 3.38 -0.92 -1.62 115.31 118.64 2gau h LEU 161 Ca 0.18 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 2gau h LEU 161 Cb 0.45 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2gau h LEU 161 CO -0.46 0.75 -0.43 -0.07 0.09 0.00 0.00 178.44 178.32 2gau h LEU 162 N 1.23 0.20 -0.68 1.67 3.38 -0.63 -0.69 115.31 119.80 2gau h LEU 162 Ca 0.34 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 58.13 2gau h LEU 162 Cb -0.14 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2gau h LEU 162 CO -0.07 0.61 0.06 0.40 0.09 0.00 0.00 178.44 179.53 2gau h ILE 163 N 0.16 1.26 -0.42 1.22 2.04 -0.53 -0.26 117.51 120.97 2gau h ILE 163 Ca 0.01 -1.08 -0.07 0.00 1.00 0.00 0.00 64.86 64.72 2gau h ILE 163 Cb 0.83 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 2gau h ILE 163 CO 0.06 0.40 -0.03 -0.07 0.00 0.00 0.00 178.15 178.52 2gau h LEU 164 N 1.00 0.76 -0.30 1.44 3.38 -1.05 -0.74 115.31 119.80 2gau h LEU 164 Ca 0.19 -0.32 0.06 0.00 0.09 0.00 0.00 57.88 57.90 2gau h LEU 164 Cb 0.49 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 2gau h LEU 164 CO 0.02 0.90 -0.07 0.50 0.09 0.00 0.00 178.44 179.88 2gau h LYS 165 N 0.60 0.01 -0.35 1.13 3.64 -0.95 0.19 116.57 120.84 2gau h LYS 165 Ca 0.12 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 2gau h LYS 165 Cb 0.52 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 2gau h LYS 165 CO 0.03 0.01 0.16 1.49 -2.27 0.00 0.00 179.45 178.87 2gau h GLU 166 N 0.01 0.50 0.00 1.90 4.57 -0.83 0.89 114.58 121.62 2gau h GLU 166 Ca 0.14 -0.08 -0.21 0.00 -1.18 0.00 0.00 59.36 58.03 2gau h GLU 166 Cb 0.22 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.68 2gau h GLU 166 CO -0.30 0.46 -1.07 -0.91 -1.18 0.00 0.00 179.01 176.01 2gau h ASN 167 N 0.42 0.00 0.00 1.04 2.35 -0.83 -3.39 115.58 115.17 2gau h ASN 167 Ca 0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 2gau h ASN 167 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 2gau h ASN 167 CO -0.01 0.97 -0.80 0.49 -1.65 0.00 0.00 177.43 176.43 2gau n PHE 168 N -3.29 0.00 -4.14 1.19 3.72 0.64 -4.92 117.46 110.66 2gau n PHE 168 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2gau n PHE 168 Cb 0.94 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.48 2gau n PHE 168 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gau n GLY 169 N 2.13 -1.24 3.58 1.37 0.00 0.31 -4.51 105.19 106.83 2gau n GLY 169 Ca 0.00 -1.26 -0.25 0.00 0.00 0.00 0.00 46.02 44.52 2gau n GLY 169 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gau s PHE 170 N 0.00 2.60 0.85 1.61 0.08 -1.26 -1.74 117.98 120.12 2gau s PHE 170 Ca 0.00 -0.24 -0.14 0.00 0.12 0.00 0.00 56.93 56.66 2gau s PHE 170 Cb 0.00 -1.19 0.21 0.00 -0.57 0.00 0.00 43.02 41.47 2gau s PHE 170 CO 0.00 0.60 0.85 0.39 -0.10 0.00 0.00 175.22 176.96 2gau n GLU 171 N -0.49 -2.13 0.03 0.44 -0.58 0.38 -4.72 120.64 113.57 2gau n GLU 171 Ca -0.08 -1.35 0.19 0.00 -0.42 0.00 0.00 57.16 55.51 2gau n GLU 171 Cb 0.58 -1.15 0.70 0.00 -0.57 0.00 0.00 31.44 30.99 2gau n GLU 171 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 2gau h ASN 172 N -2.00 0.00 0.55 1.62 2.35 -2.01 0.42 115.58 116.51 2gau h ASN 172 Ca -0.31 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 2gau h ASN 172 Cb 0.91 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.28 2gau h ASN 172 CO 0.20 0.00 0.00 -0.90 -1.65 0.00 0.00 177.43 175.08 2gau n ASP 173 N -4.34 0.00 -0.70 5.81 5.75 -1.26 -4.88 116.55 116.92 2gau n ASP 173 Ca 0.08 0.47 -0.09 0.00 -0.01 0.00 0.00 54.79 55.24 2gau n ASP 173 Cb 0.56 -0.48 -0.04 0.00 -1.03 0.00 0.00 41.12 40.12 2gau n ASP 173 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2gau n GLY 174 N 0.21 1.07 0.00 6.12 0.00 0.14 -4.75 105.19 107.99 2gau n GLY 174 Ca 0.04 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.57 2gau n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gau n ALA 175 N 1.17 0.60 -2.66 4.61 0.00 -1.26 -4.97 120.51 118.00 2gau n ALA 175 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.94 2gau n ALA 175 Cb 0.33 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.73 2gau n ALA 175 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2gau s THR 176 N -0.76 4.96 0.28 0.00 2.01 -1.26 -0.00 115.64 120.87 2gau s THR 176 Ca 0.00 1.37 -0.30 0.00 0.31 0.00 0.00 61.69 63.07 2gau s THR 176 Cb 0.00 -4.02 -0.12 0.00 0.01 0.00 0.00 72.50 68.37 2gau s THR 176 CO 0.00 0.08 1.57 0.18 -0.69 0.00 0.00 174.62 175.76 2gau n LEU 177 N 5.13 4.16 -0.64 4.42 4.77 -0.22 -0.47 117.00 134.15 2gau n LEU 177 Ca 0.01 1.14 0.01 0.00 -0.03 0.00 0.00 56.01 57.14 2gau n LEU 177 Cb 0.49 -1.57 0.05 0.00 -2.33 0.00 0.00 43.42 40.06 2gau n LEU 177 CO 0.46 0.05 0.34 -1.20 -1.33 0.00 0.00 177.39 175.71 2gau n SER 178 N 2.21 1.51 -4.13 -1.43 7.64 -0.71 -4.71 113.62 114.00 2gau n SER 178 Ca 0.09 -2.11 -0.20 0.00 1.01 0.00 0.00 58.87 57.67 2gau n SER 178 Cb 0.36 -0.49 -0.14 0.00 -1.01 0.00 0.00 64.21 62.93 2gau n SER 178 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 2gau s ILE 179 N -1.26 1.05 -0.53 0.44 2.07 -1.26 -4.98 121.20 116.73 2gau s ILE 179 Ca 0.07 -0.91 0.07 0.00 -1.41 0.00 0.00 60.65 58.47 2gau s ILE 179 Cb 0.05 -0.95 0.27 0.00 0.13 0.00 0.00 42.46 41.97 2gau s ILE 179 CO 0.02 0.04 0.71 -1.22 -1.91 0.00 0.00 174.94 172.58 2gau n TYR 180 N 2.05 2.11 -2.35 3.50 4.01 -1.26 -4.81 117.16 120.41 2gau n TYR 180 Ca -0.17 -3.91 -0.34 0.00 -0.16 0.00 0.00 57.90 53.31 2gau n TYR 180 Cb 0.55 -0.47 -0.01 0.00 -0.31 0.00 0.00 39.34 39.10 2gau n TYR 180 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2gau s LEU 181 N -2.23 3.73 0.89 7.72 1.43 -1.26 -5.00 118.68 123.96 2gau s LEU 181 Ca 0.40 1.96 -0.11 0.00 -1.03 0.00 0.00 54.13 55.34 2gau s LEU 181 Cb 0.20 -4.56 0.12 0.00 0.03 0.00 0.00 46.19 41.98 2gau s LEU 181 CO -0.07 -0.99 1.09 -0.94 0.23 0.00 0.00 176.35 175.68 2gau s SER 182 N -2.14 3.53 0.39 2.29 1.04 -1.26 -4.85 113.70 112.70 2gau s SER 182 Ca 0.68 1.57 0.06 0.00 0.48 0.00 0.00 55.95 58.74 2gau s SER 182 Cb -0.18 -2.25 0.80 0.00 0.10 0.00 0.00 66.02 64.49 2gau s SER 182 CO 0.26 -2.62 2.04 0.03 0.98 0.00 0.00 173.24 173.93 2gau h ARG 183 N -1.53 0.63 -0.34 4.02 2.47 -1.98 -1.49 114.38 116.15 2gau h ARG 183 Ca -0.49 -0.04 -0.05 0.00 -1.26 0.00 0.00 59.98 58.15 2gau h ARG 183 Cb 1.28 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 29.44 2gau h ARG 183 CO 0.53 0.41 0.03 0.93 0.56 0.00 0.00 179.97 182.43 2gau h GLU 184 N 0.64 0.59 -0.47 0.04 3.07 -1.96 0.12 114.58 116.62 2gau h GLU 184 Ca 0.19 -0.17 -0.03 0.00 -0.50 0.00 0.00 59.36 58.85 2gau h GLU 184 Cb -0.02 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.81 2gau h GLU 184 CO -0.04 0.69 0.18 0.93 -1.40 0.00 0.00 179.01 179.36 2gau h GLU 185 N 0.41 0.70 -0.61 2.33 5.08 -1.85 -0.62 114.58 120.01 2gau h GLU 185 Ca 0.10 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2gau h GLU 185 Cb 0.41 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2gau h GLU 185 CO 0.01 0.64 0.13 -0.07 -1.00 0.00 0.00 179.01 178.73 2gau h LEU 186 N 0.61 0.94 -0.00 1.33 3.38 -1.12 -0.76 115.31 119.69 2gau h LEU 186 Ca 0.15 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2gau h LEU 186 Cb 0.21 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2gau h LEU 186 CO -0.01 0.94 0.00 0.00 0.09 0.00 0.00 178.44 179.46 2gau h ALA 187 N 1.03 0.00 -0.22 1.53 0.00 -0.67 -2.68 119.26 118.26 2gau h ALA 187 Ca 0.19 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2gau h ALA 187 Cb 0.38 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2gau h ALA 187 CO 0.01 -0.43 0.13 1.15 0.00 0.00 0.00 179.25 180.10 2gau h THR 188 N -0.12 1.09 -0.78 0.00 2.02 -1.01 -1.56 112.91 112.55 2gau h THR 188 Ca 0.00 -0.23 0.16 0.00 0.77 0.00 0.00 66.41 67.12 2gau h THR 188 Cb 0.13 0.85 -0.05 0.00 -1.74 0.00 0.00 68.15 67.34 2gau h THR 188 CO -0.00 0.09 0.52 0.25 0.37 0.00 0.00 175.52 176.75 2gau h LEU 189 N 0.26 0.37 -3.01 2.58 5.85 -1.15 -2.39 115.31 117.82 2gau h LEU 189 Ca 0.08 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2gau h LEU 189 Cb 0.03 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.01 2gau h LEU 189 CO -0.01 0.18 0.00 -1.54 -0.34 0.00 0.00 178.44 176.73 2gau n SER 190 N -4.48 3.88 -3.58 1.25 3.41 -0.82 -4.98 113.62 108.31 2gau n SER 190 Ca 0.15 -2.32 -0.20 0.00 -0.26 0.00 0.00 58.87 56.25 2gau n SER 190 Cb 0.58 -0.44 0.05 0.00 -0.26 0.00 0.00 64.21 64.14 2gau n SER 190 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2gau n ASN 191 N 0.74 -2.28 -4.08 4.04 5.15 -0.70 -4.72 115.26 113.42 2gau n ASN 191 Ca 0.20 -0.77 -0.10 0.00 -0.60 0.00 0.00 54.58 53.31 2gau n ASN 191 Cb 0.69 -4.41 -0.08 0.00 -0.53 0.00 0.00 39.78 35.45 2gau n ASN 191 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gau s MET 192 N -5.64 1.23 0.54 1.20 0.23 -0.67 -5.05 119.30 111.14 2gau s MET 192 Ca 0.09 -1.39 -0.18 0.00 -1.03 0.00 0.00 55.69 53.17 2gau s MET 192 Cb -0.02 0.34 -0.06 0.00 -1.53 0.00 0.00 34.83 33.56 2gau s MET 192 CO 0.79 -0.44 1.06 0.95 -2.03 0.00 0.00 175.02 175.35 2gau s THR 193 N -4.06 3.72 0.28 3.16 -4.23 -1.26 -4.18 115.64 109.07 2gau s THR 193 Ca 0.27 0.94 0.01 0.00 -1.18 0.00 0.00 61.69 61.73 2gau s THR 193 Cb 0.04 -3.39 0.27 0.00 1.34 0.00 0.00 72.50 70.76 2gau s THR 193 CO 0.07 -0.35 1.83 0.58 -0.54 0.00 0.00 174.62 176.20 2gau h VAL 194 N 0.98 0.91 -0.34 2.29 2.07 -1.92 0.03 116.25 120.26 2gau h VAL 194 Ca -0.48 -0.33 0.06 0.00 0.82 0.00 0.00 66.70 66.77 2gau h VAL 194 Cb 1.23 -0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 2gau h VAL 194 CO 0.58 0.17 0.02 -1.28 0.02 0.00 0.00 177.57 177.08 2gau h SER 195 N 0.95 -0.10 -0.32 0.57 0.87 -1.97 0.10 113.55 113.65 2gau h SER 195 Ca 0.49 0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 61.06 2gau h SER 195 Cb 0.49 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.55 2gau h SER 195 CO -0.27 -0.01 -0.01 0.78 -0.53 0.00 0.00 176.83 176.79 2gau h ASN 196 N 0.12 0.65 0.05 6.23 2.35 -1.70 0.06 115.58 123.34 2gau h ASN 196 Ca 0.16 -0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2gau h ASN 196 Cb 0.21 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.41 2gau h ASN 196 CO -0.26 0.72 -0.02 0.00 -1.65 0.00 0.00 177.43 176.22 2gau h ALA 197 N 1.35 -0.06 -0.37 -0.83 0.00 -0.21 0.46 119.26 119.60 2gau h ALA 197 Ca 0.13 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2gau h ALA 197 Cb 0.41 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2gau h ALA 197 CO 0.02 -0.42 -0.20 -0.84 0.00 0.00 0.00 179.25 177.81 2gau h ILE 198 N -0.30 1.27 -0.23 0.00 3.07 -0.75 0.18 117.51 120.75 2gau h ILE 198 Ca -0.01 -1.28 0.02 0.00 1.55 0.00 0.00 64.86 65.14 2gau h ILE 198 Cb 0.27 1.20 -0.02 0.00 -0.27 0.00 0.00 36.82 38.00 2gau h ILE 198 CO 0.01 0.43 0.10 -0.09 -1.05 0.00 0.00 178.15 177.55 2gau h ARG 199 N 0.63 0.22 -0.34 0.16 2.43 -0.93 -1.01 114.38 115.54 2gau h ARG 199 Ca 0.09 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.12 2gau h ARG 199 Cb 0.69 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 2gau h ARG 199 CO 0.05 0.15 -0.30 1.15 -1.51 0.00 0.00 179.97 179.51 2gau h THR 200 N 0.23 1.29 -0.29 0.20 2.02 -0.39 -2.35 112.91 113.61 2gau h THR 200 Ca 0.10 -1.46 0.04 0.00 0.77 0.00 0.00 66.41 65.85 2gau h THR 200 Cb 0.04 1.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.88 2gau h THR 200 CO -0.08 0.48 0.08 -0.07 0.37 0.00 0.00 175.52 176.30 2gau h LEU 201 N 0.58 0.06 -0.52 2.58 3.38 -0.61 -0.27 115.31 120.51 2gau h LEU 201 Ca 0.06 0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.17 2gau h LEU 201 Cb 0.87 0.04 -0.10 0.00 0.09 0.00 0.00 40.66 41.56 2gau h LEU 201 CO 0.08 0.07 -0.16 -1.28 0.09 0.00 0.00 178.44 177.24 2gau h SER 202 N 0.20 -0.56 -0.85 -0.43 0.87 -1.07 -0.44 113.55 111.27 2gau h SER 202 Ca 0.13 0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 60.83 2gau h SER 202 Cb 0.12 0.35 -0.04 0.00 -0.44 0.00 0.00 62.40 62.40 2gau h SER 202 CO -0.16 -0.19 0.42 0.74 -0.53 0.00 0.00 176.83 177.11 2gau h THR 203 N -0.03 1.26 -0.54 2.23 2.02 -1.08 -1.00 112.91 115.76 2gau h THR 203 Ca 0.25 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.69 2gau h THR 203 Cb 0.41 0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 2gau h THR 203 CO -0.55 0.30 0.18 -0.26 0.37 0.00 0.00 175.52 175.56 2gau h PHE 204 N 1.20 0.81 -0.09 3.16 0.04 -0.05 0.10 116.94 122.10 2gau h PHE 204 Ca 0.29 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.99 2gau h PHE 204 Cb 0.10 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 38.00 2gau h PHE 204 CO 0.01 0.65 -0.00 0.28 -0.60 0.00 0.00 178.31 178.65 2gau h VAL 205 N 0.78 1.26 -0.99 -0.55 2.07 -0.79 -0.25 116.25 117.77 2gau h VAL 205 Ca 0.18 -0.82 0.18 0.00 0.82 0.00 0.00 66.70 67.06 2gau h VAL 205 Cb 0.21 1.62 -0.10 0.00 -1.52 0.00 0.00 31.29 31.50 2gau h VAL 205 CO -0.01 0.23 0.60 0.28 0.02 0.00 0.00 177.57 178.69 2gau h SER 206 N -0.12 0.78 -0.02 0.57 0.02 -0.86 0.13 113.55 114.05 2gau h SER 206 Ca 0.03 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2gau h SER 206 Cb 0.36 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.85 2gau h SER 206 CO 0.01 0.29 0.00 -0.62 -1.14 0.00 0.00 176.83 175.36 2gau n GLU 207 N -4.76 1.19 -3.71 3.45 1.02 -0.01 -4.92 120.64 112.90 2gau n GLU 207 Ca 0.23 -0.28 -0.26 0.00 -0.02 0.00 0.00 57.16 56.82 2gau n GLU 207 Cb 0.55 -1.41 0.06 0.00 -0.02 0.00 0.00 31.44 30.61 2gau n GLU 207 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2gau n ARG 208 N -0.59 -7.13 -0.06 3.49 1.74 0.45 -4.89 116.66 109.68 2gau n ARG 208 Ca 0.19 0.75 -0.12 0.00 -0.77 0.00 0.00 57.85 57.90 2gau n ARG 208 Cb 0.16 -5.75 -0.14 0.00 -1.02 0.00 0.00 32.46 25.71 2gau n ARG 208 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2gau n MET 209 N -4.90 0.67 -4.49 5.56 2.81 -0.14 -4.33 117.12 112.31 2gau n MET 209 Ca 0.02 0.16 -0.23 0.00 -1.81 0.00 0.00 57.70 55.84 2gau n MET 209 Cb 0.55 -1.64 -0.11 0.00 -0.71 0.00 0.00 33.22 31.31 2gau n MET 209 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2gau s LEU 210 N -6.06 2.33 -0.00 4.03 1.43 -1.11 -1.05 118.68 118.25 2gau s LEU 210 Ca -0.13 -1.38 -0.00 0.00 -1.03 0.00 0.00 54.13 51.59 2gau s LEU 210 Cb 0.07 -0.49 0.00 0.00 0.03 0.00 0.00 46.19 45.80 2gau s LEU 210 CO 0.79 -0.57 0.01 0.00 0.23 0.00 0.00 176.35 176.80 2gau s ALA 211 N -3.17 -0.02 0.02 4.21 0.00 -0.32 -4.35 121.76 118.14 2gau s ALA 211 Ca 0.36 0.03 0.08 0.00 0.00 0.00 0.00 51.96 52.43 2gau s ALA 211 Cb 0.09 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 2gau s ALA 211 CO 0.16 -0.01 -0.24 -0.51 0.00 0.00 0.00 175.76 175.16 2gau s LEU 212 N 0.04 2.24 -0.42 0.00 1.43 -1.26 -0.83 118.68 119.87 2gau s LEU 212 Ca -0.00 -0.51 0.06 0.00 -1.03 0.00 0.00 54.13 52.65 2gau s LEU 212 Cb -0.00 -1.36 0.17 0.00 0.03 0.00 0.00 46.19 45.03 2gau s LEU 212 CO -0.00 0.28 0.54 -0.62 0.23 0.00 0.00 176.35 176.78 2gau s ASP 213 N -1.06 -0.28 1.53 2.29 2.15 -0.50 -5.02 116.67 115.77 2gau s ASP 213 Ca 0.12 -1.53 0.00 0.00 0.43 0.00 0.00 52.55 51.56 2gau s ASP 213 Cb -0.10 1.21 0.00 0.00 -0.30 0.00 0.00 42.92 43.73 2gau s ASP 213 CO 0.02 -0.17 0.00 0.61 -0.17 0.00 0.00 175.17 175.46 2gau n GLY 214 N 3.83 2.69 0.18 2.66 0.00 -1.26 -1.77 105.19 111.52 2gau n GLY 214 Ca 0.15 -0.26 0.15 0.00 0.00 0.00 0.00 46.02 46.05 2gau n GLY 214 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2gau n LYS 215 N 13.06 1.02 -2.81 1.61 5.02 -1.26 -4.85 118.16 129.95 2gau n LYS 215 Ca 0.00 -0.36 -0.42 0.00 -2.02 0.00 0.00 58.31 55.51 2gau n LYS 215 Cb 0.00 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.48 2gau n LYS 215 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2gau s ARG 216 N -2.22 4.29 -0.22 1.97 0.52 -0.73 -4.53 118.95 118.03 2gau s ARG 216 Ca 0.36 1.13 -0.02 0.00 -0.52 0.00 0.00 55.73 56.69 2gau s ARG 216 Cb 0.21 -3.59 0.01 0.00 0.52 0.00 0.00 34.95 32.09 2gau s ARG 216 CO 0.41 -0.42 -0.09 0.42 0.02 0.00 0.00 175.30 175.64 2gau s ILE 217 N 2.46 2.84 -0.22 1.52 1.01 -1.26 -1.40 121.20 126.14 2gau s ILE 217 Ca 0.40 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 60.19 2gau s ILE 217 Cb -0.16 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 39.95 2gau s ILE 217 CO 0.11 0.39 0.07 -0.75 0.00 0.00 0.00 174.94 174.76 2gau s LYS 218 N 1.38 3.80 -0.38 2.79 2.20 -0.01 -1.06 119.74 128.45 2gau s LYS 218 Ca 0.04 -0.42 -0.22 0.00 -0.36 0.00 0.00 55.97 55.01 2gau s LYS 218 Cb -0.15 -3.29 0.01 0.00 -1.51 0.00 0.00 37.83 32.89 2gau s LYS 218 CO -0.06 0.00 0.74 0.42 -0.36 0.00 0.00 175.35 176.09 2gau s ILE 219 N 1.11 4.76 -0.16 5.43 1.01 0.99 -1.18 121.20 133.16 2gau s ILE 219 Ca 0.04 0.68 0.17 0.00 0.00 0.00 0.00 60.65 61.55 2gau s ILE 219 Cb -0.14 -4.20 -0.26 0.00 0.01 0.00 0.00 42.46 37.87 2gau s ILE 219 CO 0.03 -0.47 0.44 2.30 0.00 0.00 0.00 174.94 177.24 2gau n ILE 220 N 5.82 0.00 -3.47 2.92 -5.35 -0.21 -4.70 119.36 114.37 2gau n ILE 220 Ca 0.02 -0.35 -0.28 0.00 -0.27 0.00 0.00 62.75 61.87 2gau n ILE 220 Cb 0.48 0.26 -0.11 0.00 -1.74 0.00 0.00 39.64 38.54 2gau n ILE 220 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2gau s ASP 221 N -3.76 2.14 0.13 7.28 -1.08 -0.94 -4.99 116.67 115.45 2gau s ASP 221 Ca -0.04 -2.98 -0.16 0.00 -0.52 0.00 0.00 52.55 48.85 2gau s ASP 221 Cb 0.11 -0.58 -0.01 0.00 -1.46 0.00 0.00 42.92 40.98 2gau s ASP 221 CO 0.72 -0.19 1.66 0.00 0.52 0.00 0.00 175.17 177.88 2gau h ASP 223 N 0.51 0.14 -0.01 0.00 3.32 -1.99 0.72 116.42 119.10 2gau h ASP 223 Ca 0.13 0.09 -0.20 0.00 0.02 0.00 0.00 57.03 57.06 2gau h ASP 223 Cb 0.24 0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2gau h ASP 223 CO -0.01 0.09 -0.73 0.03 -1.72 0.00 0.00 179.24 176.91 2gau h ARG 224 N 0.34 0.65 -0.75 3.56 3.08 -1.97 -2.19 114.38 117.11 2gau h ARG 224 Ca 0.29 -0.51 0.06 0.00 0.07 0.00 0.00 59.98 59.89 2gau h ARG 224 Cb 0.38 0.10 -0.06 0.00 0.08 0.00 0.00 29.97 30.47 2gau h ARG 224 CO -0.32 1.13 0.44 1.25 -1.07 0.00 0.00 179.97 181.40 2gau h LEU 225 N 0.45 0.68 -0.75 3.04 5.85 -0.53 0.41 115.31 124.46 2gau h LEU 225 Ca -0.04 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2gau h LEU 225 Cb 1.33 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.21 2gau h LEU 225 CO 0.14 0.44 0.39 1.56 -0.34 0.00 0.00 178.44 180.62 2gau h GLN 226 N 0.81 1.06 -0.83 1.25 4.20 -0.76 0.39 115.11 121.23 2gau h GLN 226 Ca 0.33 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2gau h GLN 226 Cb 0.18 -0.20 -0.04 0.00 0.30 0.00 0.00 27.48 27.72 2gau h GLN 226 CO -0.18 0.81 0.52 -0.22 -0.67 0.00 0.00 178.83 179.09 2gau h LYS 227 N 1.04 1.11 -0.56 1.46 3.64 -0.73 -1.46 116.57 121.08 2gau h LYS 227 Ca 0.26 -0.09 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 2gau h LYS 227 Cb 0.07 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 2gau h LYS 227 CO -0.04 0.76 0.15 1.15 -2.27 0.00 0.00 179.45 179.21 2gau h THR 228 N 1.14 1.24 -0.81 1.00 2.02 -0.32 0.66 112.91 117.84 2gau h THR 228 Ca 0.30 -0.85 0.04 0.00 0.77 0.00 0.00 66.41 66.68 2gau h THR 228 Cb -0.08 0.73 -0.05 0.00 -1.74 0.00 0.00 68.15 67.00 2gau h THR 228 CO -0.06 0.31 0.51 0.00 0.37 0.00 0.00 175.52 176.65 2gau h ALA 229 N 1.03 1.08 0.07 6.16 0.00 -0.66 -0.46 119.26 126.48 2gau h ALA 229 Ca 0.18 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 2gau h ALA 229 Cb 0.31 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2gau h ALA 229 CO -0.00 0.31 -0.74 0.00 0.00 0.00 0.00 179.25 178.81 2gau h ARG 230 N 0.98 0.15 0.00 0.00 3.08 -0.94 -3.41 114.38 114.24 2gau h ARG 230 Ca 0.33 -0.25 -0.33 0.00 0.07 0.00 0.00 59.98 59.80 2gau h ARG 230 Cb 0.05 0.09 -0.06 0.00 0.08 0.00 0.00 29.97 30.14 2gau h ARG 230 CO -0.13 1.12 -2.04 0.43 -1.07 0.00 0.00 179.97 178.28 2gau n SER 231 N -4.28 0.55 0.00 7.04 7.64 0.23 -5.10 113.62 119.69 2gau n SER 231 Ca -0.18 0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.91 2gau n SER 231 Cb 0.71 0.38 0.00 0.00 -1.01 0.00 0.00 64.21 64.29 2gau n SER 231 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64